3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]carbonyl-7-methoxy-1H-quinolin-4-one

Systemtic Name: 3-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]carbonyl-7-methoxy-1H-quinolin-4-one Openeye Name: 3-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]-7-methoxy-1H-quinolin-4-one CAS Name: 3-[[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-7-methoxy-1H-quinolin-4-one IUPAC Name: 3-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]-7-methoxy-1H-quinolin-4-one Traditional Name: 3-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]-7-methoxy-4-quinolone Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CNC4=C(C3=O)C=CC(=C4)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CNC4=C(C3=O)C=CC(=C4)OC)C

InChI

InChI=1S/C23H25N3O5S/c1-15-4-7-21(16(2)12-15)32(29,30)26-10-8-25(9-11-26)23(28)19-14-24-20-13-17(31-3)5-6-18(20)22(19)27/h4-7,12-14H,8-11H2,1-3H3,(H,24,27)